==== Secondary Structure Definition by the program DSSP, updated CMBI version by ElmK / April 1,2000 ==== DATE=6-SEP-2013 . REFERENCE W. KABSCH AND C.SANDER, BIOPOLYMERS 22 (1983) 2577-2637 . HEADER SIGNALING PROTEIN 09-APR-13 4K2O . COMPND 2 MOLECULE: T-LYMPHOMA INVASION AND METASTASIS-INDUCING PROTE . SOURCE 2 ORGANISM_SCIENTIFIC: HOMO SAPIENS; . AUTHOR M.JOSHI,L.GAKHAR,E.J.FUENTES . 232 2 0 0 0 TOTAL NUMBER OF RESIDUES, NUMBER OF CHAINS, NUMBER OF SS-BRIDGES(TOTAL,INTRACHAIN,INTERCHAIN) . 13422.0 ACCESSIBLE SURFACE OF PROTEIN (ANGSTROM**2) . 172 74.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(J) , SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS IN PARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 43 18.5 TOTAL NUMBER OF HYDROGEN BONDS IN ANTIPARALLEL BRIDGES, SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-5), SAME NUMBER PER 100 RESIDUES . 2 0.9 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-4), SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-3), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-2), SAME NUMBER PER 100 RESIDUES . 1 0.4 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I-1), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+0), SAME NUMBER PER 100 RESIDUES . 0 0.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+1), SAME NUMBER PER 100 RESIDUES . 10 4.3 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+2), SAME NUMBER PER 100 RESIDUES . 14 6.0 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+3), SAME NUMBER PER 100 RESIDUES . 100 43.1 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+4), SAME NUMBER PER 100 RESIDUES . 4 1.7 TOTAL NUMBER OF HYDROGEN BONDS OF TYPE O(I)-->H-N(I+5), SAME NUMBER PER 100 RESIDUES . 1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26 27 28 29 30 *** HISTOGRAMS OF *** . 0 0 0 0 1 0 0 0 0 2 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 1 1 RESIDUES PER ALPHA HELIX . 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 PARALLEL BRIDGES PER LADDER . 0 0 1 2 3 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ANTIPARALLEL BRIDGES PER LADDER . 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 LADDERS PER SHEET . # RESIDUE AA STRUCTURE BP1 BP2 ACC N-H-->O O-->H-N N-H-->O O-->H-N TCO KAPPA ALPHA PHI PSI X-CA Y-CA Z-CA 1 432 A G 0 0 92 0, 0.0 2,-0.2 0, 0.0 38,-0.0 0.000 360.0 360.0 360.0 4.8 16.2 0.3 -17.9 2 433 A T - 0 0 107 1,-0.1 38,-1.4 37,-0.0 2,-0.6 -0.595 360.0-102.6 -87.2 146.8 18.6 0.2 -20.9 3 434 A V E +A 39 0A 80 -2,-0.2 36,-0.2 36,-0.2 3,-0.1 -0.575 39.0 175.3 -67.1 113.7 18.4 -2.3 -23.7 4 435 A R E - 0 0 102 34,-2.6 2,-0.3 -2,-0.6 -1,-0.2 0.766 67.1 -7.1 -88.7 -36.5 21.1 -4.9 -23.1 5 436 A K E -A 38 0A 31 33,-0.9 33,-3.0 98,-0.0 -1,-0.4 -0.960 59.8-177.8-157.2 147.7 20.1 -7.2 -25.9 6 437 A A E +A 37 0A 33 -2,-0.3 2,-0.3 31,-0.2 31,-0.2 -0.983 20.4 127.4-149.1 154.2 17.4 -7.5 -28.5 7 438 A G E -A 36 0A 8 29,-2.0 29,-3.0 -2,-0.3 2,-0.3 -0.972 56.9 -66.2 175.7 170.8 16.7 -10.1 -31.2 8 439 A A E +A 35 0A 46 -2,-0.3 2,-0.4 27,-0.2 27,-0.2 -0.660 51.4 174.8 -83.2 133.9 14.1 -12.5 -32.8 9 440 A L E -A 34 0A 2 25,-2.2 25,-2.2 -2,-0.3 2,-0.4 -0.994 29.8-139.6-141.1 134.7 13.1 -15.4 -30.6 10 441 A A E -AB 33 90A 1 80,-2.3 80,-2.4 -2,-0.4 2,-0.3 -0.794 33.8-164.6 -82.0 145.1 10.6 -18.2 -30.9 11 442 A V E +AB 32 89A 14 21,-2.5 21,-2.2 -2,-0.4 2,-0.3 -0.980 18.9 171.5-140.2 142.9 9.0 -18.8 -27.5 12 443 A K E - B 0 88A 46 76,-2.2 76,-2.7 -2,-0.3 2,-0.2 -0.991 37.1-111.1-148.8 139.5 6.9 -21.5 -25.8 13 444 A N E + B 0 87A 83 -2,-0.3 74,-0.2 74,-0.2 16,-0.2 -0.514 36.7 172.6 -64.9 141.4 5.8 -22.0 -22.2 14 445 A F E + 0 0 55 72,-2.5 12,-2.1 1,-0.5 2,-0.4 0.712 60.5 12.5-121.6 -56.3 7.5 -25.0 -20.7 15 446 A L E -CB 25 86A 1 71,-1.5 71,-2.1 10,-0.2 -1,-0.5 -0.954 65.0-164.7-121.4 148.1 6.7 -25.3 -17.0 16 447 A V E -C 24 0A 23 8,-2.5 8,-2.7 -2,-0.4 2,-0.5 -0.989 12.6-165.3-129.7 143.8 4.0 -23.5 -15.1 17 448 A H E +C 23 0A 36 -2,-0.4 6,-0.2 6,-0.2 3,-0.1 -0.872 34.5 139.2-124.5 94.8 3.5 -23.0 -11.4 18 449 A K + 0 0 163 4,-0.6 2,-0.3 -2,-0.5 -1,-0.1 0.842 60.9 42.1 -94.5 -55.2 -0.0 -21.7 -10.9 19 450 A K S S- 0 0 167 3,-0.4 -1,-0.3 -3,-0.1 -3,-0.0 -0.995 103.8 -35.4-155.3 140.6 -1.2 -23.6 -7.8 20 451 A N S S- 0 0 121 -2,-0.3 -1,-0.1 1,-0.1 211,-0.1 -0.279 103.4 -48.0-171.7 89.6 0.0 -24.4 -5.2 21 452 A K S S+ 0 0 128 209,-0.1 2,-0.6 206,-0.1 -1,-0.1 -0.370 100.5 123.4-107.6 74.9 2.9 -25.1 -4.9 22 453 A K - 0 0 112 209,-0.0 -4,-0.6 208,-0.0 -3,-0.4 -0.813 44.2-154.0-110.9 111.8 2.7 -27.4 -8.0 23 454 A V E +C 17 0A 7 -2,-0.6 2,-0.3 -6,-0.2 -6,-0.2 -0.635 25.0 176.6 -75.1 128.3 4.9 -27.2 -11.1 24 455 A E E -C 16 0A 117 -8,-2.7 -8,-2.5 -2,-0.4 2,-0.2 -0.893 36.1 -92.9-129.3 159.6 3.3 -28.8 -14.1 25 456 A S E -C 15 0A 67 -2,-0.3 -10,-0.2 -10,-0.2 2,-0.1 -0.490 49.2-111.0 -65.2 140.6 4.0 -29.2 -17.8 26 457 A A - 0 0 22 -12,-2.1 3,-0.1 -2,-0.2 -1,-0.1 -0.461 38.6 -92.9 -73.9 147.8 2.6 -26.3 -19.9 27 458 A T - 0 0 96 1,-0.1 -14,-0.1 -2,-0.1 2,-0.1 -0.332 55.8 -93.6 -55.5 140.0 -0.2 -27.1 -22.3 28 459 A R + 0 0 224 -3,-0.1 2,-0.3 -16,-0.0 -1,-0.1 -0.396 59.3 164.3 -66.5 133.2 1.2 -28.0 -25.7 29 460 A R - 0 0 162 -16,-0.2 2,-0.1 -2,-0.1 3,-0.1 -0.964 40.0 -93.1-147.5 156.1 1.4 -25.0 -28.1 30 461 A K - 0 0 186 -2,-0.3 2,-0.1 1,-0.1 -19,-0.1 -0.453 50.3-100.8 -64.3 144.7 2.9 -23.8 -31.3 31 462 A W - 0 0 40 -2,-0.1 2,-0.4 -19,-0.1 -19,-0.2 -0.438 40.5-149.2 -52.8 136.7 6.2 -21.9 -31.0 32 463 A K E -A 11 0A 78 -21,-2.2 -21,-2.5 -2,-0.1 2,-0.3 -0.980 3.9-136.2-119.7 133.9 5.4 -18.2 -31.3 33 464 A H E +A 10 0A 106 -2,-0.4 15,-0.4 -23,-0.2 2,-0.3 -0.695 30.5 163.8 -91.0 136.5 7.8 -15.7 -32.8 34 465 A Y E -A 9 0A 17 -25,-2.2 -25,-2.2 -2,-0.3 2,-0.5 -0.961 44.0-114.5-142.7 154.5 8.5 -12.3 -31.2 35 466 A W E -AD 8 46A 125 11,-2.5 11,-2.8 -2,-0.3 2,-0.5 -0.882 45.7-158.4 -86.9 128.3 11.0 -9.5 -31.3 36 467 A V E -AD 7 45A 0 -29,-3.0 -29,-2.0 -2,-0.5 2,-0.4 -0.934 15.2-171.6-124.7 127.5 12.4 -9.7 -27.8 37 468 A S E -AD 6 44A 8 7,-2.4 7,-2.9 -2,-0.5 2,-0.8 -0.958 15.7-147.8-119.1 131.8 14.2 -7.0 -25.8 38 469 A L E +AD 5 43A 0 -33,-3.0 -34,-2.6 -2,-0.4 -33,-0.9 -0.874 23.9 174.9 -95.4 111.9 16.0 -7.4 -22.5 39 470 A K E > -AD 3 42A 73 3,-2.5 3,-1.3 -2,-0.8 2,-0.5 -0.968 64.2 -43.3-118.1 116.1 15.6 -4.1 -20.6 40 471 A G T 3 S- 0 0 24 -38,-1.4 71,-0.1 -2,-0.5 70,-0.1 -0.566 125.1 -25.2 62.2-116.7 17.0 -4.2 -17.1 41 472 A C T 3 S+ 0 0 13 -2,-0.5 18,-2.6 69,-0.1 19,-0.5 -0.030 120.8 90.3-116.9 29.1 15.8 -7.5 -15.7 42 473 A T E < -DE 39 58A 31 -3,-1.3 -3,-2.5 16,-0.2 2,-0.5 -0.976 63.4-142.1-132.7 135.1 12.8 -7.9 -17.9 43 474 A L E -DE 38 57A 2 14,-3.0 14,-2.5 -2,-0.4 2,-0.5 -0.880 19.5-158.1 -93.7 125.2 12.2 -9.5 -21.3 44 475 A F E -DE 37 56A 39 -7,-2.9 -7,-2.4 -2,-0.5 2,-0.5 -0.904 3.0-151.8-106.4 130.8 9.7 -7.6 -23.4 45 476 A F E -DE 36 55A 6 10,-2.6 9,-2.2 -2,-0.5 10,-1.4 -0.904 11.0-167.9-107.7 123.0 7.9 -9.4 -26.2 46 477 A Y E -D 35 0A 58 -11,-2.8 -11,-2.5 -2,-0.5 2,-0.3 -0.923 27.4-117.5-117.0 128.8 6.8 -7.4 -29.3 47 478 A E > - 0 0 59 -2,-0.4 3,-0.8 5,-0.4 -13,-0.1 -0.513 19.7-143.6 -62.6 121.1 4.5 -8.7 -32.0 48 479 A S T 3 S+ 0 0 85 -15,-0.4 -1,-0.2 -2,-0.3 -14,-0.1 0.570 95.5 73.3 -66.2 -9.2 6.6 -8.7 -35.2 49 480 A D T 3 0 0 137 1,-0.2 -1,-0.3 0, 0.0 -2,-0.1 -0.052 360.0 360.0 -91.8 30.2 3.4 -7.6 -37.0 50 481 A G < 0 0 107 -3,-0.8 -2,-0.2 -4,-0.1 -1,-0.2 0.326 360.0 360.0-179.4 360.0 3.7 -4.1 -35.5 51 ! 0 0 0 0, 0.0 0, 0.0 0, 0.0 0, 0.0 0.000 360.0 360.0 360.0 360.0 0.0 0.0 0.0 52 490 A I 0 0 191 0, 0.0 -5,-0.4 0, 0.0 2,-0.1 0.000 360.0 360.0 360.0 136.1 4.5 -1.3 -27.4 53 491 A P - 0 0 46 0, 0.0 -7,-0.2 0, 0.0 3,-0.1 -0.364 360.0-163.1 -75.3 135.8 5.1 -4.8 -25.7 54 492 A K S S+ 0 0 107 -9,-2.2 2,-0.3 1,-0.2 -8,-0.2 0.886 79.0 13.8 -74.7 -46.2 2.5 -7.6 -25.9 55 493 A H E -E 45 0A 93 -10,-1.4 -10,-2.6 2,-0.0 2,-0.3 -0.902 62.3-161.6-128.3 158.8 4.1 -9.7 -23.0 56 494 A A E -E 44 0A 63 -2,-0.3 2,-0.5 -12,-0.2 -12,-0.2 -0.985 4.5-167.1-141.2 132.2 6.6 -9.0 -20.3 57 495 A V E -E 43 0A 23 -14,-2.5 -14,-3.0 -2,-0.3 2,-0.4 -0.982 15.4-141.9-124.0 123.1 8.5 -11.6 -18.4 58 496 A W E -E 42 0A 115 -2,-0.5 24,-0.2 -16,-0.2 -16,-0.2 -0.703 19.6-179.9 -85.5 130.9 10.4 -10.7 -15.3 59 497 A V > + 0 0 0 -18,-2.6 3,-1.2 -2,-0.4 -17,-0.2 0.206 23.8 141.6-125.4 17.4 13.6 -12.7 -15.2 60 498 A E T 3 S+ 0 0 42 -19,-0.5 22,-0.5 1,-0.2 48,-0.1 -0.318 77.9 12.5 -55.7 143.4 15.3 -11.6 -12.0 61 499 A N T 3 S+ 0 0 41 1,-0.2 -1,-0.2 47,-0.1 2,-0.1 0.825 100.4 147.3 52.4 39.7 17.0 -14.5 -10.2 62 500 A S < - 0 0 0 -3,-1.2 2,-0.4 42,-0.1 19,-0.2 -0.444 42.8-141.8 -93.5 170.5 16.6 -16.7 -13.2 63 501 A I E -F 80 0A 0 17,-2.0 17,-2.7 -2,-0.1 2,-0.4 -0.993 11.5-161.9-130.4 138.5 18.7 -19.5 -14.7 64 502 A V E +F 79 0A 0 -2,-0.4 2,-0.4 15,-0.2 15,-0.2 -0.976 12.2 179.3-120.7 133.9 19.2 -20.0 -18.5 65 503 A Q E -F 78 0A 19 13,-2.4 13,-2.7 -2,-0.4 2,-0.1 -0.999 29.1-116.9-138.3 137.0 20.4 -23.3 -19.9 66 504 A A E -F 77 0A 48 -2,-0.4 11,-0.3 11,-0.2 3,-0.1 -0.483 16.8-160.8 -65.9 138.2 21.1 -24.5 -23.4 67 505 A V > + 0 0 41 9,-2.5 3,-1.8 -2,-0.1 9,-0.3 -0.636 23.0 162.6-116.0 65.0 18.9 -27.4 -24.6 68 506 A P T 3 S+ 0 0 104 0, 0.0 -1,-0.1 0, 0.0 7,-0.1 0.737 71.1 62.6 -56.1 -23.5 21.0 -28.7 -27.5 69 507 A E T 3 + 0 0 184 -3,-0.1 5,-0.1 5,-0.1 3,-0.0 0.217 67.0 134.6 -87.7 8.7 19.1 -32.1 -27.4 70 508 A H < - 0 0 39 -3,-1.8 3,-0.1 3,-0.1 6,-0.1 -0.447 55.5-136.2 -57.6 134.1 15.7 -30.5 -28.2 71 509 A P S S+ 0 0 117 0, 0.0 -1,-0.1 0, 0.0 0, 0.0 0.965 89.6 26.5 -64.0 -58.9 14.3 -32.8 -30.9 72 510 A K S S+ 0 0 177 1,-0.0 2,-0.3 -3,-0.0 -2,-0.1 0.552 118.7 53.5 -84.7 -4.6 12.8 -30.6 -33.7 73 511 A K - 0 0 52 -3,-0.1 3,-0.3 -5,-0.0 2,-0.2 -0.963 56.3-149.7-143.3 141.7 15.0 -27.5 -33.1 74 512 A D S S+ 0 0 106 -2,-0.3 17,-0.1 1,-0.2 -5,-0.1 -0.627 81.4 33.2 -93.9 166.5 18.5 -26.1 -32.8 75 513 A F S S+ 0 0 68 1,-0.2 16,-2.3 -2,-0.2 2,-0.4 0.833 79.5 154.2 57.5 35.2 19.6 -23.0 -30.8 76 514 A V E + G 0 90A 2 -9,-0.3 -9,-2.5 -3,-0.3 2,-0.3 -0.778 17.2 177.1 -92.1 136.7 17.1 -23.7 -28.0 77 515 A F E -FG 66 89A 1 12,-2.5 12,-2.8 -2,-0.4 2,-0.5 -0.932 19.1-138.4-134.8 162.4 17.6 -22.5 -24.5 78 516 A C E -FG 65 88A 2 -13,-2.7 -13,-2.4 -2,-0.3 2,-0.6 -0.985 9.1-162.9-129.7 121.5 15.5 -22.7 -21.4 79 517 A L E -FG 64 87A 0 8,-2.4 8,-2.3 -2,-0.5 2,-0.5 -0.925 4.1-166.8-106.7 125.9 15.0 -19.9 -18.9 80 518 A S E -FG 63 86A 0 -17,-2.7 -17,-2.0 -2,-0.6 6,-0.2 -0.960 14.5-149.3-110.5 128.4 13.5 -20.9 -15.5 81 519 A N - 0 0 7 4,-2.1 3,-0.4 -2,-0.5 148,-0.1 -0.030 29.8 -95.9 -86.9-169.6 12.4 -17.9 -13.4 82 520 A S S S+ 0 0 32 -22,-0.5 150,-0.1 -24,-0.2 -21,-0.1 0.464 115.6 58.6 -89.6 0.0 12.2 -17.4 -9.6 83 521 A L S S- 0 0 85 2,-0.2 -1,-0.2 149,-0.1 149,-0.1 0.514 119.4 -91.5-106.7 -10.3 8.6 -18.5 -9.4 84 522 A G S S+ 0 0 0 1,-0.4 2,-0.3 -3,-0.4 142,-0.1 0.534 87.0 117.8 110.8 7.0 8.5 -22.1 -10.7 85 523 A D - 0 0 30 -69,-0.1 -4,-2.1 -68,-0.1 -1,-0.4 -0.721 41.4-166.3 -99.3 156.3 7.8 -21.3 -14.4 86 524 A A E -BG 15 80A 0 -71,-2.1 -72,-2.5 -2,-0.3 -71,-1.5 -0.976 1.2-160.9-141.1 155.9 10.1 -22.1 -17.3 87 525 A F E -BG 13 79A 25 -8,-2.3 -8,-2.4 -2,-0.3 2,-0.4 -0.985 11.8-138.9-139.8 138.8 10.2 -21.0 -20.9 88 526 A L E -BG 12 78A 8 -76,-2.7 -76,-2.2 -2,-0.4 2,-0.4 -0.892 22.8-176.3 -99.9 136.3 11.8 -22.4 -24.1 89 527 A F E -BG 11 77A 0 -12,-2.8 -12,-2.5 -2,-0.4 2,-0.4 -0.977 12.7-156.8-128.3 143.2 13.3 -19.9 -26.5 90 528 A Q E -BG 10 76A 37 -80,-2.4 -80,-2.3 -2,-0.4 -14,-0.2 -0.990 14.2-173.6-122.7 129.1 14.9 -20.5 -29.9 91 529 A T - 0 0 9 -16,-2.3 -82,-0.1 -2,-0.4 -17,-0.1 -0.231 37.0 -97.6-106.1-165.0 17.4 -18.1 -31.4 92 530 A T S S- 0 0 94 -84,-0.2 2,-0.3 1,-0.2 -17,-0.1 0.457 90.8 -5.8-102.3 -2.2 19.2 -17.8 -34.8 93 531 A S S > S- 0 0 39 -18,-0.2 4,-1.6 1,-0.1 -1,-0.2 -0.974 70.8 -95.3 176.8 168.1 22.5 -19.4 -34.0 94 532 A Q H > S+ 0 0 94 -2,-0.3 4,-2.0 1,-0.2 5,-0.1 0.836 120.2 52.2 -74.7 -34.0 24.8 -20.9 -31.5 95 533 A T H > S+ 0 0 89 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.893 109.8 47.8 -70.2 -39.1 26.7 -17.7 -30.9 96 534 A E H > S+ 0 0 56 2,-0.2 4,-2.2 1,-0.2 -2,-0.2 0.796 107.3 58.0 -74.1 -26.3 23.5 -15.7 -30.3 97 535 A L H X S+ 0 0 5 -4,-1.6 4,-2.2 2,-0.2 -2,-0.2 0.977 109.5 43.9 -63.4 -52.0 22.4 -18.5 -27.9 98 536 A E H X S+ 0 0 102 -4,-2.0 4,-2.2 1,-0.2 -2,-0.2 0.837 112.0 53.5 -59.8 -39.7 25.5 -17.9 -25.9 99 537 A N H X S+ 0 0 72 -4,-2.0 4,-2.3 2,-0.2 -1,-0.2 0.838 108.8 49.5 -62.0 -38.8 25.0 -14.1 -26.2 100 538 A W H X S+ 0 0 1 -4,-2.2 4,-2.3 2,-0.2 5,-0.3 0.920 111.1 48.9 -70.2 -38.6 21.5 -14.5 -24.8 101 539 A I H X S+ 0 0 12 -4,-2.2 4,-2.4 1,-0.2 5,-0.2 0.926 113.1 47.3 -63.1 -46.1 22.7 -16.6 -21.9 102 540 A T H X S+ 0 0 65 -4,-2.2 4,-1.9 1,-0.2 -1,-0.2 0.905 113.1 48.6 -63.5 -41.5 25.4 -14.1 -21.1 103 541 A A H X S+ 0 0 13 -4,-2.3 4,-2.1 2,-0.2 -1,-0.2 0.890 113.3 45.1 -71.6 -37.8 23.1 -11.1 -21.3 104 542 A I H X S+ 0 0 1 -4,-2.3 4,-2.4 2,-0.2 -2,-0.2 0.953 114.9 47.8 -71.7 -43.3 20.3 -12.6 -19.1 105 543 A H H X S+ 0 0 1 -4,-2.4 4,-2.0 -5,-0.3 -2,-0.2 0.831 111.9 51.4 -65.5 -32.0 22.8 -13.8 -16.5 106 544 A S H X S+ 0 0 14 -4,-1.9 4,-2.3 2,-0.2 -1,-0.2 0.899 108.2 49.8 -71.0 -43.1 24.5 -10.4 -16.5 107 545 A A H X S+ 0 0 2 -4,-2.1 4,-2.5 1,-0.2 -2,-0.2 0.913 113.3 48.6 -58.2 -42.4 21.2 -8.6 -16.0 108 546 A C H X S+ 0 0 0 -4,-2.4 4,-1.9 2,-0.2 -2,-0.2 0.888 108.2 52.1 -63.1 -42.4 20.5 -11.0 -13.1 109 547 A A H X S+ 0 0 0 -4,-2.0 4,-1.9 1,-0.2 -1,-0.2 0.928 112.1 48.6 -61.9 -42.0 24.0 -10.5 -11.6 110 548 A T H X S+ 0 0 27 -4,-2.3 4,-2.5 1,-0.2 -2,-0.2 0.920 108.2 51.1 -62.2 -49.5 23.3 -6.7 -11.8 111 549 A A H X S+ 0 0 17 -4,-2.5 4,-1.2 1,-0.2 -1,-0.2 0.832 109.3 53.0 -59.3 -32.2 19.8 -7.0 -10.2 112 550 A V H X S+ 0 0 6 -4,-1.9 4,-1.3 2,-0.2 3,-0.3 0.926 108.4 49.0 -69.1 -46.3 21.4 -9.0 -7.3 113 551 A A H ><>S+ 0 0 1 -4,-1.9 5,-2.4 1,-0.2 3,-0.5 0.923 110.2 50.7 -60.0 -43.4 24.0 -6.4 -6.7 114 552 A R H ><5S+ 0 0 174 -4,-2.5 3,-0.8 3,-0.2 -1,-0.2 0.786 104.8 58.2 -63.9 -26.0 21.4 -3.6 -6.6 115 553 A H H 3<5S+ 0 0 133 -4,-1.2 -1,-0.2 -3,-0.3 -2,-0.2 0.797 111.5 41.0 -73.6 -30.8 19.4 -5.7 -4.1 116 554 A H T <<5S- 0 0 67 -4,-1.3 -1,-0.3 -3,-0.5 -2,-0.2 0.136 116.3-121.1 -96.3 12.9 22.4 -5.6 -1.8 117 555 A H T < 5 + 0 0 163 -3,-0.8 2,-0.3 1,-0.2 -3,-0.2 0.843 65.0 140.4 46.7 48.0 23.0 -1.9 -2.7 118 556 A K < - 0 0 112 -5,-2.4 -1,-0.2 1,-0.1 -2,-0.1 -0.907 45.2-161.5-118.7 149.1 26.5 -2.6 -4.0 119 557 A E S S+ 0 0 175 -2,-0.3 2,-1.4 1,-0.2 3,-0.2 0.795 80.1 74.3 -97.1 -35.9 28.1 -1.1 -7.1 120 558 A D > + 0 0 85 1,-0.2 4,-1.9 -7,-0.1 -1,-0.2 -0.651 59.9 178.3 -84.4 90.3 30.8 -3.7 -7.5 121 559 A T H > S+ 0 0 28 -2,-1.4 4,-2.7 1,-0.2 5,-0.2 0.902 75.8 53.5 -59.1 -47.7 28.8 -6.6 -8.8 122 560 A L H > S+ 0 0 67 1,-0.2 4,-2.0 2,-0.2 -1,-0.2 0.895 110.1 47.2 -56.2 -44.8 31.8 -9.0 -9.2 123 561 A R H > S+ 0 0 189 1,-0.2 4,-1.7 2,-0.2 -1,-0.2 0.888 112.8 49.2 -67.3 -40.1 32.9 -8.5 -5.6 124 562 A L H X S+ 0 0 13 -4,-1.9 4,-2.6 2,-0.2 5,-0.2 0.947 108.5 51.6 -65.0 -50.0 29.4 -9.0 -4.3 125 563 A L H X S+ 0 0 0 -4,-2.7 4,-2.4 1,-0.2 -1,-0.2 0.896 110.4 49.7 -55.8 -41.1 28.8 -12.2 -6.3 126 564 A K H X S+ 0 0 110 -4,-2.0 4,-2.1 -5,-0.2 -1,-0.2 0.877 110.8 50.5 -67.2 -34.6 32.1 -13.7 -5.0 127 565 A S H X S+ 0 0 43 -4,-1.7 4,-2.1 2,-0.2 -2,-0.2 0.893 111.8 46.5 -68.6 -40.9 31.0 -12.8 -1.5 128 566 A E H X S+ 0 0 25 -4,-2.6 4,-2.1 2,-0.2 -2,-0.2 0.881 110.4 53.3 -71.1 -37.1 27.6 -14.4 -1.8 129 567 A I H X S+ 0 0 15 -4,-2.4 4,-2.2 -5,-0.2 -2,-0.2 0.942 110.0 48.0 -61.1 -47.2 29.2 -17.5 -3.4 130 568 A K H X S+ 0 0 130 -4,-2.1 4,-1.8 1,-0.2 -2,-0.2 0.905 110.9 50.8 -60.1 -47.5 31.6 -17.8 -0.4 131 569 A K H X S+ 0 0 87 -4,-2.1 4,-2.2 1,-0.2 -1,-0.2 0.865 110.7 48.9 -56.9 -44.7 28.7 -17.4 2.1 132 570 A L H X S+ 0 0 8 -4,-2.1 4,-2.8 2,-0.2 5,-0.2 0.902 107.3 55.3 -63.2 -41.5 26.6 -20.1 0.4 133 571 A E H X S+ 0 0 85 -4,-2.2 4,-1.9 1,-0.2 -2,-0.2 0.888 110.8 45.6 -59.8 -37.7 29.5 -22.4 0.4 134 572 A Q H X S+ 0 0 106 -4,-1.8 4,-2.6 2,-0.2 -1,-0.2 0.903 110.9 51.2 -71.2 -44.0 29.9 -22.0 4.1 135 573 A K H X S+ 0 0 97 -4,-2.2 4,-2.7 1,-0.2 5,-0.2 0.954 112.7 48.4 -57.4 -47.7 26.2 -22.4 4.8 136 574 A I H X S+ 0 0 10 -4,-2.8 4,-2.0 1,-0.2 -1,-0.2 0.900 110.5 49.4 -62.1 -43.1 26.2 -25.6 2.8 137 575 A D H X S+ 0 0 77 -4,-1.9 4,-2.0 -5,-0.2 -1,-0.2 0.947 113.5 46.9 -64.8 -42.8 29.2 -27.0 4.5 138 576 A M H X S+ 0 0 101 -4,-2.6 4,-2.5 1,-0.2 -2,-0.2 0.931 113.5 46.4 -63.8 -47.4 27.8 -26.3 8.0 139 577 A D H X S+ 0 0 29 -4,-2.7 4,-1.9 1,-0.2 -1,-0.2 0.806 109.0 54.7 -72.3 -26.8 24.3 -27.7 7.3 140 578 A E H X S+ 0 0 62 -4,-2.0 4,-1.8 -5,-0.2 -1,-0.2 0.920 111.7 46.3 -67.0 -43.2 25.7 -30.9 5.6 141 579 A K H X S+ 0 0 111 -4,-2.0 4,-2.1 -5,-0.2 -2,-0.2 0.922 114.6 45.4 -63.0 -46.0 27.8 -31.5 8.8 142 580 A M H X S+ 0 0 88 -4,-2.5 4,-2.5 1,-0.2 -1,-0.2 0.880 109.8 55.5 -68.1 -37.0 24.9 -30.9 11.2 143 581 A K H X S+ 0 0 38 -4,-1.9 4,-2.2 1,-0.2 -1,-0.2 0.907 109.3 46.7 -60.4 -43.0 22.5 -33.0 9.1 144 582 A K H X S+ 0 0 129 -4,-1.8 4,-2.7 2,-0.2 5,-0.2 0.895 110.1 54.2 -65.8 -40.3 24.9 -35.9 9.3 145 583 A M H X S+ 0 0 123 -4,-2.1 4,-2.1 1,-0.2 -2,-0.2 0.933 109.7 47.9 -61.3 -41.0 25.2 -35.3 13.1 146 584 A G H X S+ 0 0 10 -4,-2.5 4,-1.2 2,-0.2 -2,-0.2 0.923 110.4 50.0 -67.5 -43.1 21.5 -35.5 13.4 147 585 A E H >< S+ 0 0 85 -4,-2.2 3,-0.8 1,-0.2 4,-0.4 0.953 114.3 45.2 -60.3 -47.2 21.1 -38.7 11.4 148 586 A M H >< S+ 0 0 149 -4,-2.7 3,-0.8 1,-0.2 4,-0.4 0.847 108.9 58.2 -62.3 -34.9 23.8 -40.4 13.5 149 587 A Q H >< S+ 0 0 92 -4,-2.1 3,-1.2 -5,-0.2 -1,-0.2 0.774 89.3 76.9 -67.8 -26.0 22.2 -39.0 16.6 150 588 A L G X< S+ 0 0 49 -4,-1.2 3,-1.5 -3,-0.8 -1,-0.2 0.794 83.8 59.6 -58.6 -34.5 18.9 -40.7 15.8 151 589 A S G < S+ 0 0 112 -3,-0.8 -1,-0.2 -4,-0.4 -2,-0.1 0.763 106.2 48.9 -74.1 -20.7 19.9 -44.3 16.9 152 590 A S G < S+ 0 0 81 -3,-1.2 2,-0.7 -4,-0.4 -1,-0.3 0.210 88.3 94.2-102.1 17.0 20.6 -43.2 20.4 153 591 A V < + 0 0 32 -3,-1.5 6,-0.1 1,-0.2 -1,-0.1 -0.889 44.0 173.1-109.5 105.1 17.3 -41.2 21.0 154 592 A T + 0 0 147 -2,-0.7 2,-0.5 4,-0.1 -1,-0.2 0.794 54.9 87.7 -84.1 -27.1 14.8 -43.5 22.6 155 593 A D S > S- 0 0 93 1,-0.2 4,-2.1 2,-0.1 5,-0.2 -0.614 70.6-149.1 -77.2 124.6 12.1 -41.0 23.2 156 594 A S H > S+ 0 0 93 -2,-0.5 4,-2.6 1,-0.2 -1,-0.2 0.792 92.8 53.1 -69.1 -30.1 10.0 -40.9 20.1 157 595 A K H > S+ 0 0 133 2,-0.2 4,-2.0 1,-0.2 -1,-0.2 0.939 111.1 46.0 -71.1 -45.6 9.0 -37.2 20.4 158 596 A A H > S+ 0 0 41 2,-0.2 4,-1.6 1,-0.2 -2,-0.2 0.887 115.1 48.6 -60.5 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-65.5 -44.5 14.4 -29.2 6.8 169 607 A W H X S+ 0 0 54 -4,-2.7 4,-2.5 1,-0.2 -2,-0.2 0.818 107.8 58.6 -63.8 -29.4 18.1 -29.2 6.2 170 608 A E H X S+ 0 0 46 -4,-1.4 4,-1.4 2,-0.2 -1,-0.2 0.963 110.6 40.6 -65.0 -52.2 17.5 -31.5 3.2 171 609 A Q H X S+ 0 0 65 -4,-2.1 4,-2.1 2,-0.2 -2,-0.2 0.904 115.5 51.0 -58.9 -46.1 15.3 -29.0 1.6 172 610 A N H X S+ 0 0 53 -4,-2.6 4,-2.5 1,-0.2 -2,-0.2 0.904 107.0 53.8 -62.8 -40.6 17.5 -26.0 2.5 173 611 A L H X S+ 0 0 20 -4,-2.5 4,-2.2 2,-0.2 -1,-0.2 0.863 107.0 52.1 -62.5 -35.4 20.6 -27.7 1.1 174 612 A E H X S+ 0 0 3 -4,-1.4 4,-2.3 1,-0.2 -1,-0.2 0.958 112.1 46.0 -63.1 -49.5 18.8 -28.2 -2.2 175 613 A Q H X S+ 0 0 53 -4,-2.1 4,-2.5 1,-0.2 -2,-0.2 0.863 112.4 49.4 -61.4 -40.1 17.9 -24.5 -2.3 176 614 A F H X S+ 0 0 29 -4,-2.5 4,-2.0 2,-0.2 -1,-0.2 0.871 111.0 50.1 -68.2 -38.3 21.4 -23.4 -1.3 177 615 A Q H X S+ 0 0 18 -4,-2.2 4,-2.2 2,-0.2 -2,-0.2 0.905 111.9 48.2 -67.5 -40.8 22.9 -25.6 -4.0 178 616 A M H X S+ 0 0 0 -4,-2.3 4,-2.2 1,-0.2 -2,-0.2 0.905 112.3 48.8 -63.2 -45.8 20.5 -24.2 -6.6 179 617 A D H X S+ 0 0 27 -4,-2.5 4,-2.7 1,-0.2 -1,-0.2 0.864 111.4 50.2 -62.5 -37.4 21.3 -20.6 -5.5 180 618 A L H X S+ 0 0 5 -4,-2.0 4,-2.5 2,-0.2 -2,-0.2 0.901 109.0 50.5 -71.2 -39.3 25.0 -21.4 -5.6 181 619 A F H X S+ 0 0 9 -4,-2.2 4,-2.0 2,-0.2 -2,-0.2 0.931 111.7 49.8 -60.3 -45.1 24.7 -22.8 -9.1 182 620 A R H X S+ 0 0 17 -4,-2.2 4,-2.1 2,-0.2 -2,-0.2 0.939 110.2 48.1 -62.6 -48.8 22.8 -19.7 -10.1 183 621 A F H X S+ 0 0 16 -4,-2.7 4,-2.3 1,-0.2 -1,-0.2 0.879 109.6 53.7 -61.8 -39.3 25.4 -17.3 -8.7 184 622 A R H X S+ 0 0 94 -4,-2.5 4,-2.1 2,-0.2 -1,-0.2 0.876 108.1 51.2 -62.2 -35.2 28.2 -19.3 -10.4 185 623 A C H X S+ 0 0 0 -4,-2.0 4,-1.9 2,-0.2 -2,-0.2 0.896 111.1 47.9 -61.8 -41.2 26.2 -18.8 -13.7 186 624 A Y H X S+ 0 0 0 -4,-2.1 4,-1.2 1,-0.2 -2,-0.2 0.879 113.2 47.6 -70.7 -34.8 26.0 -15.1 -13.0 187 625 A L H X S+ 0 0 27 -4,-2.3 4,-1.2 2,-0.2 6,-0.3 0.857 109.5 52.2 -74.9 -36.5 29.7 -14.9 -12.2 188 626 A A H >X>S+ 0 0 8 -4,-2.1 5,-1.5 1,-0.2 4,-1.3 0.912 105.6 56.7 -66.2 -37.6 30.7 -16.9 -15.3 189 627 A S H 3<5S+ 0 0 14 -4,-1.9 -1,-0.2 1,-0.3 -2,-0.2 0.857 110.6 43.5 -61.6 -37.1 28.6 -14.4 -17.4 190 628 A L H 3<5S+ 0 0 63 -4,-1.2 -1,-0.3 1,-0.2 -2,-0.2 0.657 121.2 39.0 -80.4 -22.2 30.7 -11.5 -16.1 191 629 A Q H <<5S- 0 0 101 -4,-1.2 -2,-0.2 -3,-0.6 -1,-0.2 0.381 103.8-119.0-108.1 -3.9 34.1 -13.3 -16.4 192 630 A G T <5 + 0 0 72 -4,-1.3 -3,-0.2 1,-0.2 -4,-0.1 0.784 66.6 147.6 60.6 26.5 33.6 -15.1 -19.7 193 631 A G < - 0 0 40 -5,-1.5 2,-0.2 -6,-0.3 -1,-0.2 -0.316 56.4 -86.4 -83.7 172.1 34.1 -18.3 -17.7 194 632 A E - 0 0 190 1,-0.1 -1,-0.1 -3,-0.1 3,-0.1 -0.572 49.6-103.0 -79.8 141.2 32.5 -21.6 -18.4 195 633 A L - 0 0 65 -2,-0.2 -10,-0.1 1,-0.1 -1,-0.1 -0.205 46.0 -90.9 -55.0 150.8 29.0 -22.3 -16.8 196 634 A P - 0 0 22 0, 0.0 -1,-0.1 0, 0.0 -15,-0.0 -0.275 54.0 -86.3 -63.4 157.5 28.9 -24.5 -13.8 197 635 A N > - 0 0 83 1,-0.2 4,-1.4 -3,-0.1 3,-0.2 -0.513 32.4-159.2 -71.1 113.4 28.3 -28.2 -14.4 198 636 A P H > S+ 0 0 49 0, 0.0 4,-1.8 0, 0.0 -1,-0.2 0.872 90.1 55.7 -62.0 -36.8 24.6 -29.1 -14.7 199 637 A K H > S+ 0 0 172 1,-0.2 4,-1.2 2,-0.2 -2,-0.0 0.874 103.2 55.3 -68.4 -35.3 25.1 -32.8 -13.9 200 638 A R H 4 S+ 0 0 190 -3,-0.2 3,-0.4 1,-0.2 4,-0.3 0.916 107.6 50.6 -57.7 -43.9 26.9 -31.9 -10.6 201 639 A L H >< S+ 0 0 7 -4,-1.4 3,-2.0 1,-0.2 -2,-0.2 0.918 104.9 55.8 -61.4 -43.6 23.8 -29.9 -9.6 202 640 A L H >< S+ 0 0 42 -4,-1.8 3,-1.7 1,-0.3 -1,-0.2 0.769 94.5 67.4 -65.4 -25.7 21.4 -32.7 -10.3 203 641 A A T 3< S+ 0 0 77 -4,-1.2 -1,-0.3 -3,-0.4 -2,-0.2 0.640 94.2 61.0 -65.5 -15.6 23.3 -35.1 -8.0 204 642 A F T < S+ 0 0 92 -3,-2.0 -1,-0.3 -4,-0.3 2,-0.2 0.400 74.7 120.3 -93.4 -2.1 22.1 -32.8 -5.1 205 643 A A < - 0 0 9 -3,-1.7 -3,-0.0 -4,-0.1 19,-0.0 -0.483 62.6-130.5 -63.4 128.5 18.4 -33.4 -5.9 206 644 A S > - 0 0 12 -2,-0.2 4,-2.4 -36,-0.1 5,-0.2 -0.250 26.5-100.2 -70.8 166.2 16.7 -35.0 -2.8 207 645 A R H > S+ 0 0 190 2,-0.2 4,-2.4 1,-0.2 5,-0.2 0.900 122.4 51.1 -57.5 -46.0 14.6 -38.1 -3.2 208 646 A P H > S+ 0 0 67 0, 0.0 4,-2.3 0, 0.0 -1,-0.2 0.878 110.8 50.6 -64.3 -30.4 11.2 -36.2 -3.1 209 647 A T H > S+ 0 0 5 2,-0.2 4,-2.8 1,-0.2 5,-0.2 0.924 108.1 51.6 -70.8 -43.3 12.6 -33.9 -5.9 210 648 A K H X S+ 0 0 106 -4,-2.4 4,-2.1 2,-0.2 -1,-0.2 0.904 110.1 50.0 -56.4 -42.4 13.6 -36.9 -8.0 211 649 A V H X S+ 0 0 54 -4,-2.4 4,-2.1 2,-0.2 -2,-0.2 0.954 111.2 48.8 -57.9 -51.0 10.1 -38.2 -7.6 212 650 A A H X S+ 0 0 27 -4,-2.3 4,-2.3 1,-0.3 -2,-0.2 0.911 110.3 50.2 -59.9 -44.7 8.6 -34.9 -8.6 213 651 A M H X>S+ 0 0 1 -4,-2.8 5,-1.8 2,-0.2 4,-1.4 0.886 107.0 55.5 -59.1 -41.1 10.8 -34.6 -11.6 214 652 A G H <5S+ 0 0 41 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.910 107.3 50.1 -61.2 -39.7 9.8 -38.2 -12.6 215 653 A R H <5S+ 0 0 192 -4,-2.1 -2,-0.2 1,-0.2 -1,-0.2 0.874 111.4 47.0 -64.0 -39.5 6.2 -37.0 -12.5 216 654 A L H <5S- 0 0 21 -4,-2.3 -1,-0.2 2,-0.2 -2,-0.2 0.726 107.0-131.0 -70.6 -20.6 7.0 -34.0 -14.7 217 655 A G T <5S+ 0 0 59 -4,-1.4 2,-0.4 -5,-0.2 -3,-0.2 0.684 73.0 107.8 74.9 19.5 8.8 -36.4 -16.9 218 656 A I < - 0 0 32 -5,-1.8 2,-0.6 -6,-0.2 -2,-0.2 -0.960 43.8-177.5-139.7 120.6 11.8 -34.0 -16.9 219 657 A F + 0 0 126 -2,-0.4 2,-0.3 -3,-0.1 3,-0.1 -0.882 43.1 115.3-114.2 93.3 15.3 -34.3 -15.2 220 658 A S S > S- 0 0 34 -2,-0.6 4,-2.3 1,-0.1 5,-0.2 -0.951 79.8-101.1-151.9 164.1 17.2 -31.1 -16.0 221 659 A V H > S+ 0 0 7 -2,-0.3 4,-2.6 1,-0.2 5,-0.2 0.895 122.4 57.3 -53.2 -39.6 18.6 -28.0 -14.2 222 660 A S H > S+ 0 0 6 2,-0.2 4,-2.2 1,-0.2 -1,-0.2 0.888 108.9 39.4 -64.8 -46.0 15.5 -26.3 -15.5 223 661 A S H > S+ 0 0 0 2,-0.2 4,-2.1 1,-0.2 -1,-0.2 0.866 116.0 53.3 -73.8 -34.6 12.9 -28.6 -13.9 224 662 A F H X S+ 0 0 0 -4,-2.3 4,-2.1 2,-0.2 -2,-0.2 0.925 110.6 47.6 -60.1 -46.0 15.0 -28.8 -10.7 225 663 A H H X S+ 0 0 7 -4,-2.6 4,-3.0 -5,-0.2 5,-0.3 0.934 110.1 51.4 -63.8 -46.6 15.1 -25.1 -10.5 226 664 A A H X S+ 0 0 0 -4,-2.2 4,-2.2 1,-0.2 -1,-0.2 0.870 109.8 50.1 -58.8 -39.3 11.4 -24.7 -11.1 227 665 A L H X S+ 0 0 26 -4,-2.1 4,-0.9 2,-0.2 -1,-0.2 0.924 114.7 43.0 -67.1 -44.5 10.6 -27.2 -8.3 228 666 A V H ><>S+ 0 0 2 -4,-2.1 5,-1.7 2,-0.2 3,-1.1 0.954 115.5 48.2 -63.3 -48.8 12.8 -25.5 -5.8 229 667 A A H ><5S+ 0 0 4 -4,-3.0 3,-1.8 1,-0.3 -2,-0.2 0.870 103.0 63.5 -66.5 -33.4 11.7 -22.0 -6.8 230 668 A A H 3<5S+ 0 0 1 -4,-2.2 -1,-0.3 1,-0.3 -2,-0.2 0.791 95.2 58.0 -59.6 -33.1 8.1 -23.1 -6.6 231 669 A R T <<5S- 0 0 67 -3,-1.1 -1,-0.3 -4,-0.9 -2,-0.2 0.264 121.4-113.3 -70.6 14.4 8.6 -23.7 -2.8 232 670 A T T < 5 0 0 124 -3,-1.8 -3,-0.2 1,-0.1 -2,-0.2 0.874 360.0 360.0 36.1 40.5 9.5 -20.0 -2.9 233 671 A G < 0 0 27 -5,-1.7 -1,-0.1 -6,-0.2 -61,-0.1 -0.142 360.0 360.0-107.6 360.0 12.7 -21.8 -2.0